SCHEMBL30258554

SCHEMBL30258554

COC(=O)CCCCC1CCC(C=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.41
KDM5A P29375 1/20 0.39
KDM7A Q6ZMT4 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
PHF8 Q9UPP1 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
EPHX2 P34913 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
RECQL P46063 1/20 0.37
TRPV1 Q8NER1 1/20 0.36
PPARG P37231 2/20 0.36
NR2E3 Q9Y5X4 2/20 0.36
NCOR2 Q9Y618 2/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8561323 0.88 TSHR (0.41) TSHRALDH1A1EPHX2TDP1MAPT
SCHEMBL11694216 0.86 TSHR (0.54) TSHRLMNAALDH1A1KDM5AKDM7A
SCHEMBL11695325 0.86 TSHR (0.54) TSHRLMNAALDH1A1KDM5AKDM7A
SCHEMBL11858995 0.86 TSHR (0.54) TSHRLMNAALDH1A1KDM5AKDM7A
SCHEMBL11692421 0.86 TSHR (0.54) TSHRLMNAALDH1A1KDM5AKDM7A
SCHEMBL11695993 0.86 TSHR (0.54) TSHRLMNAALDH1A1KDM5AKDM7A
SCHEMBL7747296 0.84 TSHR (0.38) TSHRALDH1A1EPHX2TDP1MAPT
SCHEMBL7747291 0.84 TSHR (0.38) TSHRALDH1A1EPHX2TDP1MAPT
SCHEMBL7747301 0.84 TSHR (0.38) TSHRALDH1A1EPHX2TDP1MAPT
SCHEMBL31520116 0.83 EPHX2 (0.40) ALDH1A1KDM5AKDM7AKDM4CPHF8

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023059792-A1 CORONAVIRUS NON-STRUCTURAL PROTEIN 3 DEGRADING COMPOUNDS C4 THRAPEUTICS, INC. (US) 2023-04-13 WO disclosed